SCHEMBL7320803

SCHEMBL7320803

CCC(O)CC(O)C(CC1CCCCC1)N(C(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)[C@@H](Cc1c[nH]cn1)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 19/20 0.57
▸ CTSE P14091 7/20 0.57
▸ CTSD P07339 6/20 0.56
▸ PGA5 P0DJD9 4/20 0.56
▸ PGC P20142 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7320800 0.82 REN (0.77) RENCTSECTSDPGA5PGC
SCHEMBL7436682 0.79 REN (0.73) REN
SCHEMBL7322193 0.78 REN (0.38) RENCTSECTSDPGA5
SCHEMBL7316049 0.76 REN (0.42) REN
SCHEMBL7311937 0.76 REN (0.39) REN
SCHEMBL7385303 0.72 REN (0.47) REN
SCHEMBL7323158 0.72 REN (0.43) REN
SCHEMBL7403552 0.72 REN (0.44) REN
SCHEMBL7299338 0.71 REN (0.46) RENPGC
SCHEMBL9523860 0.71 REN (0.46) RENPGC

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5198426-A RENIN INHIBITORS CONTAINING C-TERMINAL DIHYDROXY AMIDES WARNER-LAMBERT COMPANY (US) 1993-03-30 — — US disclosed
EP-0380805-A1 Renin inhibitors containing C-terminal dihydroxy amides WARNER-LAMBERT COMPANY (US) 1990-08-08 — — EP disclosed
WO-1990007521-A1 RENIN INHIBITORS CONTAINING C-TERMINAL DIHYDROXY AMIDES WARNER-LAMBERT COMPANY (US) 1990-07-12 — — WO disclosed
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